5-[(2-hexyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxymethyl]furan-2-carboxylic acid

Systemtic Name: 5-[(2-hexyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxymethyl]furan-2-carboxylic acid Openeye Name: 5-[(2-hexyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxymethyl]furan-2-carboxylic acid CAS Name: 5-[(2-hexyl-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-3-yl)oxymethyl]-2-furancarboxylic acid IUPAC Name: 5-[(2-hexyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxymethyl]furan-2-carboxylic acid Traditional Name: 5-[(2-hexyl-6-keto-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxymethyl]-2-furoic acid Formula: C25H28O6 MolecularWeight: 424.48622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C3=C(CCCC3)C(=O)O2)OCC4=CC=C(O4)C(=O)O

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C3=C(CCCC3)C(=O)O2)OCC4=CC=C(O4)C(=O)O

InChI

InChI=1S/C25H28O6/c1-2-3-4-5-8-16-13-20-18-9-6-7-10-19(18)25(28)31-23(20)14-22(16)29-15-17-11-12-21(30-17)24(26)27/h11-14H,2-10,15H2,1H3,(H,26,27)